anti-pain drug nv2 #226 Output Download CSV

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Gene Protein
 
  The docking scores are in the AutoDock Vina metric.
L: Sulfasalazine
PDE4B_HUMAN

Docking Scores:
-9.73 -9.54 -8.96
Similarity Score:
40.94%
Best Match:
CHEMBL576479

L: Aceclofenac
PDE4B_HUMAN

Docking Scores:
-8.71 -8.31 -8.15
Similarity Score:
48.44%
Best Match:
CHEMBL3315251

L: Alclofenac
PDE4B_HUMAN

Docking Scores:
-6.68 -6.96 -6.98
Similarity Score:
37.27%
Best Match:
CHEMBL511115

L: Curcumin
PDE4B_HUMAN

Docking Scores:
-8.61 -8.73 -8.97
Similarity Score:
35.97%
Best Match:
CHEMBL403367

L: Fentanyl
PDE4B_HUMAN

Docking Scores:
-7.99 -8.12 -8.66
Similarity Score:
39.84%
Best Match:
CHEMBL37386

L: Sulfasalazine
PDE5A_HUMAN

Docking Scores:
-9.56 -10.11 -9.91
Similarity Score:
33.19%
Best Match:
CHEMBL79579

L: Aceclofenac
PDE5A_HUMAN

Docking Scores:
-8.21 -8.64 -8.52
Similarity Score:
28.57%
Best Match:
CHEMBL332898

L: Alclofenac
PDE5A_HUMAN

Docking Scores:
-6.45 -6.64 -6.46
Similarity Score:
33.33%
Best Match:
CHEMBL291127

L: Curcumin
PDE5A_HUMAN

Docking Scores:
-8.48 -8.80 -8.40
Similarity Score:
29.61%
Best Match:
CHEMBL158374

L: Fentanyl
PDE5A_HUMAN

Docking Scores:
-8.25 -8.36 -8.02
Similarity Score:
31.82%
Best Match:
CHEMBL555171

L: Sulfasalazine
PERM_HUMAN

Docking Scores:
-8.51 -8.92 -8.58
Similarity Score:
28.12%
Best Match:
CHEMBL3741401

L: Aceclofenac
PERM_HUMAN

Docking Scores:
-8.18 -8.48 -8.09
Similarity Score:
36.19%
Best Match:
CHEMBL686

L: Alclofenac
PERM_HUMAN

Docking Scores:
-7.69 -7.67 -7.62
Similarity Score:
33.63%
Best Match:
CHEMBL86

L: Curcumin
PERM_HUMAN

Docking Scores:
-7.54 -7.99 -7.74
Similarity Score:
27.47%
Best Match:
CHEMBL3925807

L: Fentanyl
PERM_HUMAN

Docking Scores:
-7.81 -8.46 -8.03
Similarity Score:
38.94%
Best Match:
CHEMBL2347029

L: Sulfasalazine
PGH1_SHEEP

Docking Scores:
-9.54 -9.57 -9.55
Similarity Score:
32.14%
Best Match:
CHEMBL298031

L: Aceclofenac
PGH1_SHEEP

Docking Scores:
-7.02 -8.47 -8.57
Similarity Score:
80.46%
Best Match:
CHEMBL139

L: Alclofenac
PGH1_SHEEP

Docking Scores:
-6.52 -6.90 -6.82
Similarity Score:
59.70%
Best Match:
CHEMBL12952

L: Curcumin
PGH1_SHEEP

Docking Scores:
-8.92 -9.47 -9.61
Similarity Score:
54.64%
Best Match:
CHEMBL229955

L: Fentanyl
PGH1_SHEEP

Docking Scores:
-9.40 -8.71 -8.01
Similarity Score:
40.83%
Best Match:
CHEMBL3775653